8004-3788 Screening compound: 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-N'~1~-[(E,2E)-1-methyl-3-phenyl-2-propenylidene]heptanohydrazide

8004-3788 Screening compound: 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-N'~1~-[(E,2E)-1-methyl-3-phenyl-2-propenylidene]heptanohydrazide
8004-3788 Screening compound: 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-N'~1~-[(E,2E)-1-methyl-3-phenyl-2-propenylidene]heptanohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-3788
2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-N'~1~-[(E,2E)-1-methyl-3-phenyl-2-propenylidene]heptanohydrazide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8004-3788

Molecular Formula

C17H11F13N2O (C17 H11 F13 N2 O)

Compound Name

2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-N'~1~-[(E,2E)-1-methyl-3-phenyl-2-propenylidene]heptanohydrazide

IUPAC name

2233445566777-tridecafluoro-N'-[(2E3E)-4-phenylbut-3-en-2-ylidene]heptanehydrazide

SMILES

C/C(/C=C/c1ccccc1)=N\NC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)=O

InChI

InChI=1S/C17H11F13N2O/c1-9(7-8-10-5-3-2-4-6-10)31-32-11(33)12(18,19)13(20,21)14(22,23)15(24,25)16(26,27)17(28,29)30/h2-8H,1H3,(H,32,33)

InChI Key

OLBLEKPEMHQGKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00321493

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.27

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.159

Distribution Coefficient, logD

5.778

Water Solubility, LogSw

-5.67

Polar Surface Area

35.194

Acid Dissociation Constant (pKa)

7.25

Base Dissociation Constant (pKb)

-0.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.18

References: we are preparing a list of scientific research reports with 8004-3788 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-3788?
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What is the minimum amount of 8004-3788 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-3788
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-3788
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8004-3788 available by request